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{
"id": "jvasp-20613",
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"structure_string": "Ti2 Sb2\n1.0\n2.024891 -3.507213 0.000000\n2.024891 3.507213 -0.000000\n0.000000 0.000000 6.251538\nTi Sb\n2 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.333333 0.666667 0.750000 Sb\n0.666667 0.333333 0.250000 Sb\n",
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{
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{
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{
"id": "jvasp-8399",
"created_at": "2022-09-04T14:37:07.708286Z",
"updated_at": "2022-09-04T14:37:07.708322Z",
"structure_string": "Ti2 S4\n1.0\n4.930232 -0.000000 -2.242322\n-1.019831 4.823600 -2.242322\n-0.085826 -0.105869 6.352547\nTi S\n2 4\ndirect\n0.250000 0.750000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.880582 0.875000 0.250001 S\n0.624999 0.119418 0.750000 S\n0.369417 0.375000 0.250000 S\n0.124999 0.630582 0.750000 S\n",
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"volume": 148.73208811779728,
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{
"id": "jvasp-93361",
"created_at": "2022-09-04T14:36:31.182992Z",
"updated_at": "2022-09-04T14:36:31.183018Z",
"structure_string": "Ti2 S4\n1.0\n-3.359948 -0.018373 0.595864\n-1.716583 -2.949540 0.002998\n0.363333 -2.174217 11.607129\nTi S\n2 4\ndirect\n0.081052 0.582495 0.754289 Ti\n-0.081052 0.417505 0.245712 Ti\n0.787293 0.290421 0.632279 S\n0.212708 0.709579 0.367721 S\n0.375015 0.874618 0.876104 S\n0.624986 0.125383 0.123896 S\n",
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{
"id": "jvasp-93778",
"created_at": "2022-09-04T14:36:14.574926Z",
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"structure_string": "Ti2 S4\n1.0\n-1.675895 -2.902758 -0.000000\n-1.675895 2.902758 0.000000\n0.000000 0.000000 -12.012392\nTi S\n2 4\ndirect\n0.666643 0.333354 0.750000 Ti\n0.333354 0.666643 0.250000 Ti\n0.666685 0.333313 0.125154 S\n0.333313 0.666685 0.874845 S\n0.333313 0.666685 0.625154 S\n0.666685 0.333313 0.374845 S\n",
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{
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"created_at": "2022-09-04T14:36:21.835350Z",
"updated_at": "2022-09-04T14:36:21.835370Z",
"structure_string": "Ti2 S2 Cl2\n1.0\n4.834351 -0.000021 -0.000012\n0.000020 7.159944 -0.045445\n0.000018 0.021372 3.430949\nTi S Cl\n2 2 2\ndirect\n0.500000 0.889177 -0.000016 Ti\n0.000001 0.110822 0.500016 Ti\n0.500001 0.132622 0.500038 S\n-0.000000 0.867377 -0.000039 S\n0.499999 0.644606 0.499924 Cl\n0.000001 0.355393 0.000076 Cl\n",
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"spacegroup": 59
},
{
"id": "jvasp-31842",
"created_at": "2022-09-04T14:38:07.382936Z",
"updated_at": "2022-09-04T14:38:07.382946Z",
"structure_string": "Ti2 S2 Cl12 O2\n1.0\n6.135858 0.030862 -0.160616\n-2.965276 6.602183 -2.308994\n-0.025999 0.049465 10.771080\nTi S Cl O\n2 2 12 2\ndirect\n0.928971 0.761349 0.854321 Ti\n0.071028 0.238651 0.145679 Ti\n0.363227 0.013561 0.304197 S\n0.636772 0.986439 0.695803 S\n0.181388 0.672759 0.941732 Cl\n0.956926 0.188159 0.668426 Cl\n0.818611 0.327241 0.058268 Cl\n0.207698 0.118356 0.934734 Cl\n0.041461 0.724559 0.655246 Cl\n0.403793 0.522343 0.195831 Cl\n0.545576 0.767284 0.507403 Cl\n0.792302 0.881644 0.065266 Cl\n0.454423 0.232716 0.492597 Cl\n0.043073 0.811840 0.331573 Cl\n0.596206 0.477657 0.804169 Cl\n0.958539 0.275441 0.344754 Cl\n0.693437 0.896848 0.788563 O\n0.306563 0.103152 0.211437 O\n",
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"elements": [
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{
"id": "jvasp-14772",
"created_at": "2022-09-04T14:38:11.273542Z",
"updated_at": "2022-09-04T14:38:11.273569Z",
"structure_string": "Ti2 S2\n1.0\n1.667649 -2.888453 0.000000\n1.667649 2.888453 -0.000000\n0.000000 -0.000000 6.391636\nTi S\n2 2\ndirect\n0.333333 0.666667 0.250000 Ti\n0.666667 0.333333 0.750000 Ti\n0.000000 0.000000 0.000000 S\n0.000000 0.000000 0.500000 S\n",
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"volume": 61.57607215549855,
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{
"id": "jvasp-34349",
"created_at": "2022-09-04T14:37:12.694721Z",
"updated_at": "2022-09-04T14:37:12.694757Z",
"structure_string": "Ti2 S2\n1.0\n1.639928 -2.840439 0.000000\n1.639928 2.840439 0.000000\n0.000000 -0.000000 6.438459\nTi S\n2 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.333333 0.666668 0.250000 S\n0.666668 0.333333 0.750000 S\n",
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{
"id": "jvasp-115322",
"created_at": "2022-09-04T14:38:46.081287Z",
"updated_at": "2022-09-04T14:38:46.081302Z",
"structure_string": "Ti2 S1 O2\n1.0\n3.435385 -0.000000 0.000000\n-1.717693 2.975131 -0.000000\n-0.000000 -0.000000 6.058991\nTi S O\n2 1 2\ndirect\n0.666668 0.333333 0.788633 Ti\n0.333334 0.666666 0.211368 Ti\n0.000000 0.000000 0.500000 S\n0.666668 0.333333 0.133321 O\n0.333334 0.666666 0.866679 O\n",
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{
"id": "jvasp-100241",
"created_at": "2022-09-04T14:36:35.917386Z",
"updated_at": "2022-09-04T14:36:35.917410Z",
"structure_string": "Ti2 Ru1 Rh1\n1.0\n3.782899 -0.000000 2.184058\n1.260967 3.566552 2.184058\n0.000000 0.000000 4.368116\nTi Ru Rh\n2 1 1\ndirect\n0.750001 0.750000 0.750001 Ti\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 Ru\n0.500001 0.500000 0.500001 Rh\n",
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